Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | PGR | P06401 | 3/20 | 0.54 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | BRD4 | O60885 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL26994672 | 0.83 | MAPT (0.67) | MAPTKDM4EROCK2NPC1RAB9A | |
| SCHEMBL6086189 | 0.76 | MAPT (0.71) | MAPTKDM4ENPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL28099312 | 0.76 | MAPT (0.74) | MAPTKDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27884806 | 0.75 | KCNJ1 (0.57) | MAPTKDM4ERXFP1GAA | |
| SCHEMBL26994676 | 0.75 | MAOA (0.59) | MAPTKDM4EALDH1A1RXFP1PGR | |
| SCHEMBL292832 | 0.75 | PGR (0.75) | PGRNR3C1NR3C2 | |
| SCHEMBL17783820 | 0.74 | ROCK2 (1.00) | ROCK2 | |
| SCHEMBL29606212 | 0.73 | MAPT (0.66) | MAPTKDM4ENPC1ALDH1A1PGR | |
| SCHEMBL4163167 | 0.73 | PGR (0.73) | MAPTKDM4EALDH1A1PGRNR3C1 | |
| SCHEMBL7831891 | 0.72 | HDAC1 (0.67) | MAPTKDM4ENPC1RAB9ASMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2086921-A2 | SYNTHESIS OF SELECTED STEREOISOMERS OF CERTAIN SUBSTITUTED ALCOHOLS | Bausch & Lomb Incorporated (US) | 2009-08-12 | — | — | EP | disclosed |
| WO-2008060799-A2 | SYNTHESIS OF SELECTED STEREOISOMERS OF CERTAIN SUBSTITUTED ALCOHOLS | BAUSCH & LOMB INCORPORATED (US) | 2008-05-22 | — | — | WO | disclosed |